Vitas-M small molecule compound

2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl benzoate

Catalog ID
STK257883
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1OC(=O)c1ccccc1)C3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H17NO4 MW 359.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO4/c24-20-18-14-10-11-15(12-14)19(18)21(25)23(20)16-8-4-5-9-17(16)27-22(26)13-6-2-1-3-7-13/h1-11,14-15,18-19H,12H2
InChIKey
QRWVWHPOXKDOIS-UHFFFAOYSA-N
Synonyms

2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)phenylbenzoate
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4OC(=O)C5=CC=CC=C5
InChI=1SC22H17NO4c24201814101115(1214)19(18)21(25)23(20)16845917(16)2722(26)136213713h11114151819H12H2
MFCD03186803
ZINC000101327796
ZINC000239175834

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.